Pentane-1,5-diyl diacrylate

Name: Pentane-1,5-diyl diacrylate
SKU: PI36840854
Rating: 5 (1 reviews)

Cat. No.: PI36840854

Product Details Other Identifiers Computed Properties

CAS	36840-85-4
Purity	97% (stabilized with MEHQ)
Molecular Formula	C11H16O4
Molecular Weight	212.24
Molar Refractivity	56.61

Pubchem ID	93195
InChI Key	XAMCLRBWHRRBCN-UHFFFAOYSA-N
MDL Number	MFCD00078444

Aromatic Heavy Atoms Number	0
BBB Permeant	Yes
Bioavailability Score	0.55
Brenk	2.0 alert
Consensus Log Po/w	2.18
CYP1A2Inhibitor	No
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Egan	0.0
Fraction Csp3	0.45
Ghose	None
GI Absorption	High
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4.0
Hydrogen Bond Donor Count	0.0
Leadlikeness	2.0
Lipinski	0.0
Log Kp (Skin Permeation)	-5.99 cm/s
Log Po/w (iLOGP)	2.97
Log Po/w (MLOGP)	1.66
Log Po/w (SILICOS-IT)	2.41
Log Po/w (WLOGP)	1.62
Log Po/w (XLOGP3)	2.26
Muegge	0.0
PAINS	0.0 alert
P-gp Substrate	No
Rotatable Bond Count	10
Synthetic Accessibility	2.1
Topological Polar Surface Area	52.6 Å²
Veber	0.0

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